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#ifndef CONVERTPDBTOSMILEJCHEM_H
#define	CONVERTPDBTOSMILEJCHEM_H
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#include "libraries.h"
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class ConvertPDBToSmileJChem {
    
  private:

    String*  locationDB;
    String*  filenameOut;
    String*  listLigandError;
    
  protected:

  public:

    ConvertPDBToSmileJChem();
    ConvertPDBToSmileJChem(const ConvertPDBToSmileJChem&);
    ConvertPDBToSmileJChem(const ConvertPDBToSmileJChem*);
    ~ConvertPDBToSmileJChem();

    void    LocationDB(String*);
    void    FilenameOut(String*);
    void    ListLigandError(String*);

    String* LocationDB(void);
    String* FilenameOut(void);
    String* ListLigandError(void);

    bool    ConvertPDBLigandsToSmiles();

};
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#endif
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